(2E)-2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene]acenaphthylen-1-one

Formula:C25H27N7O Mutagenic:high Tumorigenic:high Reproductive Effective:high (2E)-2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene]acenaphthylen-1-one is not a drug-like molecule.

MolName	(2E)-2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene]acenaphthylen-1-one
MolecularFormula	C25H27N7O
Smiles	O=C(c1cccc2cccc3c12)/C3=N/Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1
InChI	InChI=1S/C25H27N7O/c33-22-19-12-8-10-17-9-7-11-18(20(17)19)21(22)29-30-23-26-24(31-13-3-1-4-14-31)28-25(27-23)32-15-5-2-6-16-32/h7-12H,1-6,13-16H2,(H,26,27,28,30)
InChIK	SVQSFHRTMICBNF-UHFFFAOYSA-N
TotalMolweight	441.537
Molweight	441.537
MonoisotopicMass	441.227708
CLogP	6.5608
CLogS	-7.515
H Acceptors	8
H Donors	1
TotalSurfaceArea	333.78
Relative PSA	0.22775
PolarSurfaceArea	86.61
Druglikeness	2.7095
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions
Shape Index	0.42424
Fragments	1
Non HAtoms	33
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	6
Small Rings	6
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	10
Symmetricatoms	10
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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